SCHEMBL20033111

SCHEMBL20033111

OB(O)c1cccc2oc3c(-c4cccc5ccccc45)cccc3c12

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 2/20 0.41
▸ PRKDC P78527 4/20 0.40
▸ PIK3CD O00329 2/20 0.40
▸ PIK3CB P42338 2/20 0.40
▸ MAOA P21397 2/20 0.38
▸ MAOB P27338 1/20 0.38
▸ KDM4E B2RXH2 3/20 0.38
▸ HSD17B10 Q99714 2/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ HPGD P15428 2/20 0.38
▸ GAA P10253 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ ESR1 P03372 1/20 0.36
▸ ESR2 Q92731 1/20 0.36
▸ MGLL Q99685 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ ALOX15 P16050 1/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL29352268 0.85 KDM4E (0.47) PRKDCKDM4EHSD17B10ALDH1A1HPGD
SCHEMBL21823987 0.85 KDM4E (0.47) PRKDCKDM4EHSD17B10ALDH1A1HPGD
SCHEMBL23824073 0.84 ALOX5 (0.44) ALOX5PRKDCPIK3CDPIK3CBMAOA
SCHEMBL21042330 0.81 MAOA (0.40) MAOAKDM4EALDH1A1
SCHEMBL25775070 0.80 ALDH1A1 (0.46) ALOX5PRKDCPIK3CDPIK3CBMAOA
SCHEMBL26486965 0.80 ALOX5 (0.40) ALOX5PRKDCMAOAMAOBKDM4E
SCHEMBL31286356 0.79 ALOX5 (0.47) ALOX5PRKDCPIK3CDPIK3CBKDM4E
SCHEMBL17252607 0.79 ALOX5 (0.47) ALOX5PRKDCPIK3CDPIK3CBKDM4E
SCHEMBL21102639 0.78 ALOX5 (0.56) ALOX5PRKDCPIK3CDPIK3CBMAOA
SCHEMBL29496940 0.78 ALOX5 (0.56) ALOX5PRKDCPIK3CDPIK3CBMAOA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9938287-B1 Blue fluorescence dopant compound and organic electroluminescent device using the same NANJING TOPTO MATERIALS CO.,LTD. (CN) 2018-04-10 — — US disclosed
US-9938287-B1 Blue fluorescence dopant compound and organic electroluminescent device using the same NANJING TOPTO MATERIALS CO.,LTD. (CN) 2018-04-10 — — US disclosed
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